16-Hydroxycleroda-3,13-Dien-15,16-Olide

CAS	141979-19-3
Synonyms	2(5H)-Furanone, 5-hydroxy-4-[2-[(1S,2R,4aR,8aR)-1,2,3,4,4a,7,8,8a-octahydro-1,2,4a,5-tetramethyl-1-naphthalenyl]ethyl]-
IUPAC Name	3-[2-[(1S,2R,4aR,8aR)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-2-hydroxy-2H-furan-5-one
Molecular Weight	318.45
Molecular Formula	C20H30O3
Canonical SMILES	C[C@@H]1CC[C@@]2([C@@H]([C@@]1(C)CCC3=CC(=O)OC3O)CCC=C2C)C
InChI	InChI=1S/C20H30O3/c1-13-6-5-7-16-19(13,3)10-8-14(2)20(16,4)11-9-15-12-17(21)23-18(15)22/h6,12,14,16,18,22H,5,7-11H2,1-4H3/t14-,16+,18?,19+,20+/m1/s1
InChI Key	LVSCWEDTMWAASP-RQRNCZJESA-N
Boiling Point	465.6±40.0 °C
Purity	98%
Density	1.057±0.06 g/ml
pKa	10.01±0.40
Appearance	Solid